2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide

C25H21NO3 — CID 1352449

IUPAC2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C25H21NO3/c27-25(18-29-24-13-10-20-8-4-5-9-21(20)16-24)26-22-11-14-23(15-12-22)28-17-19-6-2-1-3-7-19/h1-16H,17-18H2,(H,26,27)
InChIKeyBDGQZVCHKHFUGN-UHFFFAOYSA-N
MW383.45 g/mol
LogP5.44
Rot. Bonds7

About 2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide

2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide (PubChem CID 1352449) has the molecular formula C25H21NO3 and a molecular weight of 383.45 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide
PubChem CID1352449
Molecular FormulaC25H21NO3
Molecular Weight383.45 g/mol
Exact Mass383.15
IUPAC Name2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C25H21NO3/c27-25(18-29-24-13-10-20-8-4-5-9-21(20)16-24)26-22-11-14-23(15-12-22)28-17-19-6-2-1-3-7-19/h1-16H,17-18H2,(H,26,27)
InChIKeyBDGQZVCHKHFUGN-UHFFFAOYSA-N
XLogP5.44
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.45
LogP ≤ 55.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide?
The IUPAC name of 2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide (CID 1352449) is 2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide.
What is the SMILES notation for 2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide?
The canonical SMILES for 2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide is O=C(COc1ccc2ccccc2c1)Nc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide?
The InChIKey is BDGQZVCHKHFUGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21NO3/c27-25(18-29-24-13-10-20-8-4-5-9-21(20)16-24)26-22-11-14-23(15-12-22)28-17-19-6-2-1-3-7-19/h1-16H,17-18H2,(H,26,27).
What are the key properties of 2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide?
2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide has a molecular weight of 383.45 g/mol, XLogP of 5.44, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide is sourced from PubChem (CID 1352449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).